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--- exercises:2017_uzh_cmest:pdos [2017/10/20 15:04] – jglan
+++ exercises:2017_uzh_cmest:pdos [2017/10/23 11:10] – tmueller
@@ Line 1: / Line 1: @@
+======= Projected density of states and Band structure for WO$_3$ =======
 In this exercise, you will carry out Density Of States(DOS) and band structure calculation using K-point sampling for Cubic lattice WO$_3$. The reference DOS and band structure you can find in [[http://pubs.acs.org/doi/abs/10.1021/cm3032225|this paper]]
@@ Line 5: / Line 5: @@
 {{:exercises:2017_uzh_cmest:wo3.jpeg?1200|}}
-======= Projected density of states for WO$_3$ =======
+====== Getting the PDOS ======
-In the following exercise we are going to look at the density of states of WO$_3$:
+In the following exercise we are going to look at the density of states of <chem>WO3</chem>:
 Similar to the previous exercise we write the coordinates in term of the unit cell:
@@ Line 133: / Line 134: @@
 </note>
-======= Getting the band structure of WO$_3$ Lattice =======
+====== Getting the band structure of WO$_3$ Lattice ======
-To get the band structure for WO3, only a few changes are required compared to the previous example for [[PDOS|calculating the PDOS]]:
+To get the band structure for <chem>WO3</chem>, only a few changes are required compared to the previous example for [[PDOS|calculating the PDOS]]:
 <code - WO3-bs.inp>